Geometry & MOs

Info

ID:	70194
PubChem CID:	47211610
Reduced:	NOCl2S2H11C12 (1)
Stoich.:	ABC2D2E11F12 (1)
Weight, g/mol:	283.135448
ΔH_f, kcal/mol:	-2.02
Dipole, Da:	4.42
IP(EA), eV:	-9.3(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(carbamoylamino)-N-[(5-ethylthiophen-2-yl)methyl]pentanamide

Drug info:

PubChemData

Smile

CCC1=CC=C(S1)CNC(=O)C2=C(SC(=C2)Cl)Cl

DOS

IR

Vibrations