Geometry & MOs

Info

ID:	134097
PubChem CID:	51643659
Reduced:	N2O5C23H26 (1)
Stoich.:	A2B5C23D26 (1)
Weight, g/mol:	477.175599
ΔH_f, kcal/mol:	-120.54
Dipole, Da:	5.77
IP(EA), eV:	-8.93(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(cyclopentylsulfamoyl)-4-methoxy-N-[(2S)-2-pyrrolidin-1-yl-2-thiophen-2-ylethyl]benzamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=O)[C@H]2CCCC[C@H]2C(=O)OCC3=CC(=CC=C3)[N+](=O)[O-]

DOS

IR

Vibrations