Geometry & MOs

Info

ID:	443314
PubChem CID:	135258529
Reduced:	INC5H9 (2)
Stoich.:	ABC5D9 (2)
Weight, g/mol:	431.154659
ΔH_f, kcal/mol:	13.34
Dipole, Da:	1.95
IP(EA), eV:	-8.46(-1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-[(2Z)-2-(1-chloroethylidene)-3-ethenyliminooxan-4-ylidene]amino]-3-methyl-4-phenylpiperazine-1-carbothioamide

Drug info:

PubChemData

Smile

CC(C)/C(=N/I)/N(C1CCCCC1)I

DOS

IR

Vibrations