Geometry & MOs

Info

ID:	321265
PubChem CID:	126665636
Reduced:	N2O2C17H20 (1)
Stoich.:	A2B2C17D20 (1)
Weight, g/mol:	256.157563
ΔH_f, kcal/mol:	-48.12
Dipole, Da:	4.52
IP(EA), eV:	-9.48(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(3-aminophenyl)-phenylmethyl]amino]propan-1-ol

Drug info:

PubChemData

Smile

CC(CO)NC(C1=CC=CC=C1)C2=CC(=CC=C2)C(=O)N

DOS

IR

Vibrations