Geometry & MOs

Info

ID:	198170
PubChem CID:	79060905
Reduced:	ClN2C17H29 (1)
Stoich.:	AB2C17D29 (1)
Weight, g/mol:	172.193949
ΔH_f, kcal/mol:	-10.66
Dipole, Da:	4.04
IP(EA), eV:	-8.34(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-3-N,3-N-dimethylhexane-3,4-diamine

Drug info:

PubChemData

Smile

CCC(CC)(C(CC1=CC=C(C=C1)Cl)NCC)N(C)C

DOS

IR

Vibrations