Geometry & MOs

Info

ID:	302050
PubChem CID:	124349057
Reduced:	NSO3C21H21 (1)
Stoich.:	ABC3D21E21 (1)
Weight, g/mol:	444.171893
ΔH_f, kcal/mol:	-70.19
Dipole, Da:	5.9
IP(EA), eV:	-8.8(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4S)-2,2-dimethyl-3,4-dihydrochromen-4-yl]-4-methoxy-3-(pyrrolidine-1-carbonyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1(C[C@H](C2=CC=CC=C2O1)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)C

DOS

IR

Vibrations