Geometry & MOs

Info

ID:	185674
PubChem CID:	77329648
Reduced:	N3O4C15H17 (2)
Stoich.:	A3B4C15D17 (2)
Weight, g/mol:	464.190714
ΔH_f, kcal/mol:	-217.09
Dipole, Da:	4.61
IP(EA), eV:	-9.57(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydrazinyl-3-phenylpropanoic acid;propanedioic acid

Drug info:

PubChemData

Smile

CC(C(=O)NC(C)C(=O)N1CCCC1C(=O)NC(CC2=CC=CC=C2)C(=O)C3=C(C(=CC=C3)N4C(=O)CCC4=O)[N+](=O)[O-])N

DOS

IR

Vibrations