Geometry & MOs

Info

ID:	270113
PubChem CID:	103629074
Reduced:	ClFNOSC12H13 (1)
Stoich.:	ABCDEF12G13 (1)
Weight, g/mol:	238.113984
ΔH_f, kcal/mol:	-62.14
Dipole, Da:	3.1
IP(EA), eV:	-8.91(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyano-N-(2-prop-2-enylsulfanylethyl)cyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

C=CCSCCNC(=O)C1=C(C=CC(=C1)Cl)F

DOS

IR

Vibrations