Geometry & MOs

Info

ID:	196808
PubChem CID:	78881216
Reduced:	O2N3C20H23 (1)
Stoich.:	A2B3C20D23 (1)
Weight, g/mol:	292.121178
ΔH_f, kcal/mol:	-21.81
Dipole, Da:	5.9
IP(EA), eV:	-8.66(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-methyl-3-nitrophenyl)methyl]naphthalen-2-amine

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)N(C=N2)CC(=O)N(C)CC3=CC(=CC=C3)OC

DOS

IR

Vibrations