Geometry & MOs

Info

ID:	182786
PubChem CID:	76938202
Reduced:	SO2C12H16 (1)
Stoich.:	AB2C12D16 (1)
Weight, g/mol:	315.080826
ΔH_f, kcal/mol:	-51.7
Dipole, Da:	1.72
IP(EA), eV:	-9.36(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-[1-(N'-hydroxycarbamimidoyl)-4-methylcyclohexyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC=CCOCCCC(=O)C1=CC=CS1

DOS

IR

Vibrations