Geometry & MOs

Info

ID:	353313
PubChem CID:	127284642
Reduced:	N2O3C16H22 (1)
Stoich.:	A2B3C16D22 (1)
Weight, g/mol:	380.176979
ΔH_f, kcal/mol:	-104.14
Dipole, Da:	3.44
IP(EA), eV:	-8.99(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclopentylsulfonyl-N-[2-(3-methylmorpholin-4-yl)ethyl]benzamide

Drug info:

PubChemData

Smile

CC1COCCN1CCNC(=O)C2=CC3=C(COC3)C=C2

DOS

IR

Vibrations