Geometry & MOs

Info

ID:	206150
PubChem CID:	80213195
Reduced:	ClSN2C17H25 (1)
Stoich.:	ABC2D17E25 (1)
Weight, g/mol:	304.19732
ΔH_f, kcal/mol:	-5.6
Dipole, Da:	5.46
IP(EA), eV:	-8.35(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[cyclopentyl(3-methylbutyl)amino]-4-methylbenzenecarbothioamide

Drug info:

PubChemData

Smile

CC(C)CCN(C1CCCC1)C2=C(C=CC(=C2)Cl)C(=S)N

DOS

IR

Vibrations