Geometry & MOs

Info

ID:	323724
PubChem CID:	126675826
Reduced:	ClNOH16C17 (1)
Stoich.:	ABCD16E17 (1)
Weight, g/mol:	222.184447
ΔH_f, kcal/mol:	-15.39
Dipole, Da:	3.72
IP(EA), eV:	-9.38(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,2Z)-4-[(Z)-2-amino-2-(methylideneamino)ethenyl]-2-ethylidene-5-N-methylhex-4-ene-1,5-diamine

Drug info:

PubChemData

Smile

CC(=O)N1CC(C2=C(C1)C=CC(=C2)Cl)C3=CC=CC=C3

DOS

IR

Vibrations