Geometry & MOs

Info

ID:	224270
PubChem CID:	85341017
Reduced:	NO2C16H33 (1)
Stoich.:	AB2C16D33 (1)
Weight, g/mol:	271.142842
ΔH_f, kcal/mol:	-142.25
Dipole, Da:	3.72
IP(EA), eV:	-9.68(2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexylsulfanyl-N,N,3-trimethylpent-4-enethioamide

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC1C(C(N1)CO)O

DOS

IR

Vibrations