Geometry & MOs

Info

ID:	196607
PubChem CID:	78852747
Reduced:	ClO2N4C20H25 (1)
Stoich.:	AB2C4D20E25 (1)
Weight, g/mol:	331.029747
ΔH_f, kcal/mol:	-47.2
Dipole, Da:	6.81
IP(EA), eV:	-8.76(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dichloro-N-[1-(4-chlorophenyl)ethyl]-N-cyclopropylcyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CCN(CC1=CC(=CC=C1)Cl)C(=O)C2CCN(CC2)C3=NC=CC(=N3)OC

DOS

IR

Vibrations