Geometry & MOs

Info

ID:	26377
PubChem CID:	645560
Reduced:	O2N5C18H27 (1)
Stoich.:	A2B5C18D27 (1)
Weight, g/mol:	454.123229
ΔH_f, kcal/mol:	1.58
Dipole, Da:	4.9
IP(EA), eV:	-8.64(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,4-dimethoxyphenyl)ethyl]-3-pyrrolidin-1-ylsulfonylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(C2=CC=C(C=C2)OC)C3=NN=NN3CCOC

DOS

IR

Vibrations