Geometry & MOs

Info

ID:	29403
PubChem CID:	833553
Reduced:	NOCl2H13C18 (1)
Stoich.:	ABC2D13E18 (1)
Weight, g/mol:	287.989089
ΔH_f, kcal/mol:	-1.72
Dipole, Da:	3.82
IP(EA), eV:	-8.99(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,4-dichlorophenyl)carbamothioyl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC=C2CC(=O)NC3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations