Geometry & MOs

Info

ID:	235719
PubChem CID:	92710500
Reduced:	SN3O4C24H29 (1)
Stoich.:	AB3C4D24E29 (1)
Weight, g/mol:	475.133255
ΔH_f, kcal/mol:	-135.85
Dipole, Da:	9.99
IP(EA), eV:	-9.2(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-acetyl-N-[2-(2-chlorophenyl)ethyl]-5-pyrrolidin-1-ylsulfonyl-2,3-dihydroindole-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CCNC(=O)[C@H]2CC3=C(N2C(=O)C)C=CC(=C3)S(=O)(=O)N4CCCC4

DOS

IR

Vibrations