Geometry & MOs

Info

ID:	131899
PubChem CID:	51276162
Reduced:	O2N4C21H22 (1)
Stoich.:	A2B4C21D22 (1)
Weight, g/mol:	382.156243
ΔH_f, kcal/mol:	-22.89
Dipole, Da:	0.91
IP(EA), eV:	-8.62(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-methylpropanamide

Drug info:

PubChemData

Smile

C1CN(CCN1C(=O)CC2=CNC3=CC=CC=C32)C(=O)NC4=CC=CC=C4

DOS

IR

Vibrations