Geometry & MOs

Info

ID:	296300
PubChem CID:	117566937
Reduced:	N2C15H26 (1)
Stoich.:	A2B15C26 (1)
Weight, g/mol:	226.123676
ΔH_f, kcal/mol:	-19.05
Dipole, Da:	1.41
IP(EA), eV:	-8.43(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=C(C(=CC=C1)CC)NCCC(C)(C)N

DOS

IR

Vibrations