Geometry & MOs

Info

ID:	351427
PubChem CID:	127280315
Reduced:	ON3C8H11 (2)
Stoich.:	AB3C8D11 (2)
Weight, g/mol:	379.192963
ΔH_f, kcal/mol:	-2.73
Dipole, Da:	2.7
IP(EA), eV:	-8.85(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-methyl-1-(4-methylphenyl)sulfonyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1C2=NNC(=O)C=C2)C(=O)N(C)CCN3CCCC3

DOS

IR

Vibrations