Geometry & MOs

Info

ID:	183703
PubChem CID:	77060149
Reduced:	OSN3C6H13 (1)
Stoich.:	ABC3D6E13 (1)
Weight, g/mol:	227.145619
ΔH_f, kcal/mol:	-18.5
Dipole, Da:	4.41
IP(EA), eV:	-8.7(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4-propylcycloheptylidene)amino]thiourea

Drug info:

PubChemData

Smile

CCC(=NNC(=S)N)COC

DOS

IR

Vibrations