Geometry & MOs

Info

ID:	185550
PubChem CID:	77312971
Reduced:	O7C10H18 (1)
Stoich.:	A7B10C18 (1)
Weight, g/mol:	538.114077
ΔH_f, kcal/mol:	-324.38
Dipole, Da:	2.72
IP(EA), eV:	-10.2(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-chloro-3-(1-methylpyrrolidin-3-yl)oxyphenyl]-2-(3,5-difluorophenyl)-4,5-dimethoxybenzenesulfonamide

Drug info:

PubChemData

Smile

C1C(C(OC1C2C(C(C(O2)CO)O)O)CO)O

DOS

IR

Vibrations