Geometry & MOs

Info

ID:	235857
PubChem CID:	92710918
Reduced:	SO3N4C18H24 (1)
Stoich.:	AB3C4D18E24 (1)
Weight, g/mol:	390.136176
ΔH_f, kcal/mol:	-88.34
Dipole, Da:	9.89
IP(EA), eV:	-8.44(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-(3-acetylphenyl)-1-(1-methylimidazol-4-yl)sulfonylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)[C@@H]2CCCN(C2)S(=O)(=O)C3=CN(C=N3)C)C

DOS

IR

Vibrations