Geometry & MOs

Info

ID:	269976
PubChem CID:	103621605
Reduced:	NOC5H9 (2)
Stoich.:	ABC5D9 (2)
Weight, g/mol:	286.078525
ΔH_f, kcal/mol:	-110.95
Dipole, Da:	2.72
IP(EA), eV:	-9.53(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclohexyl-3-[2-(trifluoromethylsulfanyl)ethyl]thiourea

Drug info:

PubChemData

Smile

CCC(=O)N1CCCC(C1)C(=O)NC

DOS

IR

Vibrations