Geometry & MOs

Info

ID:	296198
PubChem CID:	117560446
Reduced:	N2C13H22 (1)
Stoich.:	A2B13C22 (1)
Weight, g/mol:	238.168128
ΔH_f, kcal/mol:	-7.25
Dipole, Da:	1.49
IP(EA), eV:	-8.27(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(3,4-dimethoxyphenyl)-3-methylbutane-1,2-diamine

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC(CN)C(C)C

DOS

IR

Vibrations