Geometry & MOs

Info

ID:	54995
PubChem CID:	17389638
Reduced:	NSC7H15 (1)
Stoich.:	ABC7D15 (1)
Weight, g/mol:	263.098
ΔH_f, kcal/mol:	-16.14
Dipole, Da:	1.4
IP(EA), eV:	-8.63(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[cyclopentyl(isocyano)methyl]sulfonyl-4-methylbenzene

Drug info:

PubChemData

Smile

CSCC1CCCCN1

DOS

IR

Vibrations