Geometry & MOs

Info

ID:	339646
PubChem CID:	127261636
Reduced:	SN3C14H21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	329.052024
ΔH_f, kcal/mol:	29.64
Dipole, Da:	5.74
IP(EA), eV:	-8.63(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-[cyclohexyl-(3,4-dichlorophenyl)methylidene]amino]thiourea

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)C(C)C/C=N/NC(=S)N

DOS

IR

Vibrations