Geometry & MOs

Info

ID:	407531
PubChem CID:	135080278
Reduced:	SN2H10C12 (1)
Stoich.:	AB2C10D12 (1)
Weight, g/mol:	191.076871
ΔH_f, kcal/mol:	60.21
Dipole, Da:	7.49
IP(EA), eV:	-8.08(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexylthiophene-3-carbonitrile

Drug info:

PubChemData

Smile

CN1C2=C(C3=CC=CC=C31)C(=S)NC=C2

DOS

IR

Vibrations