Geometry & MOs

Info

ID:	249407
PubChem CID:	103089199
Reduced:	FSCl2N2O2C13H17 (1)
Stoich.:	ABC2D2E2F13G17 (1)
Weight, g/mol:	216.129634
ΔH_f, kcal/mol:	-121.84
Dipole, Da:	5.19
IP(EA), eV:	-9.06(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethylamino)-5-methylsulfanylpentanamide

Drug info:

PubChemData

Smile

CC1(CCNCC1)CNS(=O)(=O)C2=C(C(=C(C=C2)Cl)F)Cl

DOS

IR

Vibrations