Geometry & MOs

Info

ID:	433285
PubChem CID:	135173422
Reduced:	SN4O6H30C33 (1)
Stoich.:	AB4C6D30E33 (1)
Weight, g/mol:	598.224991
ΔH_f, kcal/mol:	-84.38
Dipole, Da:	10.33
IP(EA), eV:	-7.99(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-methoxy-3-[[3-[3-(3-methylbenzoyl)imidazolidin-1-yl]phenyl]sulfamoyl]phenyl]-N,N-dimethylbenzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC2=C(C(=O)C2=O)NC3=CC(=CC=C3)NS(=O)(=O)C4=C(C=CC(=C4)C5=CC(=CC=C5)C(=O)N(C)C)OC

DOS

IR

Vibrations