From owner-chemistry@ccl.net Fri Apr 10 09:08:00 2009 From: "Sharan sara180681^gmail.com" To: CCL Subject: CCL:G: Please Help me NMR INPUT FILE FOR GAUSSAIN 03 Message-Id: <-39056-090410005113-3518-bUD/UDsjEOnS3wlj/oC4ew]![server.ccl.net> X-Original-From: Sharan Content-Type: multipart/alternative; boundary=000e0cd14b0287353004672c1c6c Date: Fri, 10 Apr 2009 10:21:01 +0530 MIME-Version: 1.0 Sent to CCL by: Sharan [sara180681===gmail.com] --000e0cd14b0287353004672c1c6c Content-Type: text/plain; charset=ISO-8859-1 Content-Transfer-Encoding: 7bit Dear Friends I am new to Gaussian i am doing my research in spectroscopy investigation using Gaussian. I am struck in giving NMR input file for Gaussian. 1) How to specify the isotopes 2) How to change the solvents for NMR I don't know how to specify these requirements while giving NMR Input. Is there somebody to give hand to my problem , it will helpful for me... Advance thanks -- SARAVANAN.I Jr. Scientist Chemoinformatics --000e0cd14b0287353004672c1c6c Content-Type: text/html; charset=ISO-8859-1 Content-Transfer-Encoding: quoted-printable Dear Friends


I am new to Gaussian i am do= ing my research in=A0spectroscopy=A0investigation=A0using Gaussian. I am st= ruck in giving NMR input file for Gaussian.

1) =A0= How to specify the isotopes
2) How to change the solvents for NMR=A0

I do= n't know how to specify these=A0requirements=A0while giving NMR Input. = Is there somebody to give hand to my problem , it will helpful for me...

Advance thanks
--
SARAVANAN.I
Jr. Sci= entist Chemoinformatics



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