Geometry & MOs

Info

ID:	149515
PubChem CID:	53789188
Reduced:	N2O5C11H14 (1)
Stoich.:	A2B5C11D14 (1)
Weight, g/mol:	544.243418
ΔH_f, kcal/mol:	-135.72
Dipole, Da:	4.31
IP(EA), eV:	-8.99(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(4-acetylphenyl)methyl-(2,2-diphenylacetyl)amino]-5-[[amino(nitramido)methylidene]amino]pentanamide

Drug info:

PubChemData

Smile

CC(=O)OCNC(=O)NC1=CC=C(C=C1)COO

DOS

IR

Vibrations