Geometry & MOs

Info

ID:	296295
PubChem CID:	117566843
Reduced:	N2C13H22 (1)
Stoich.:	A2B13C22 (1)
Weight, g/mol:	226.123676
ΔH_f, kcal/mol:	-9.02
Dipole, Da:	1.55
IP(EA), eV:	-7.96(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(5-chloro-2-methylphenyl)-2,2-dimethylpropane-1,3-diamine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NCC(C)(C)CN)C

DOS

IR

Vibrations