Geometry & MOs

Info

ID:	35296
PubChem CID:	7979645
Reduced:	N3O5C17H17 (1)
Stoich.:	A3B5C17D17 (1)
Weight, g/mol:	418.119858
ΔH_f, kcal/mol:	-99.88
Dipole, Da:	8.89
IP(EA), eV:	-8.81(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenacyl 2-[[4-(propan-2-ylsulfamoyl)benzoyl]amino]acetate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])O

DOS

IR

Vibrations