Geometry & MOs

Info

ID:	311212
PubChem CID:	126589925
Reduced:	N2O7C10H16 (1)
Stoich.:	A2B7C10D16 (1)
Weight, g/mol:	320.200097
ΔH_f, kcal/mol:	-328.21
Dipole, Da:	4.94
IP(EA), eV:	-10.67(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-N'-[amino(phenyl)methyl]-1-(1,2-dihydropyridin-5-yl)-2-phenylethane-1,2-diamine

Drug info:

PubChemData

Smile

CC(CC(=O)O)NC(=O)N[C@@H](CCC(=O)O)C(=O)O

DOS

IR

Vibrations