Geometry & MOs

Info

ID:	62007
PubChem CID:	26716916
Reduced:	NO6C20H23 (1)
Stoich.:	AB6C20D23 (1)
Weight, g/mol:	354.157957
ΔH_f, kcal/mol:	-210.67
Dipole, Da:	6.87
IP(EA), eV:	-8.61(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 4-[[2-[(2-phenylacetyl)amino]acetyl]amino]benzoate

Drug info:

PubChemData

Smile

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2OC)OC)OC

DOS

IR

Vibrations