Geometry & MOs

Info

ID:	199163
PubChem CID:	79208554
Reduced:	ON4C16H22 (1)
Stoich.:	AB4C16D22 (1)
Weight, g/mol:	379.97387
ΔH_f, kcal/mol:	-3.95
Dipole, Da:	4.14
IP(EA), eV:	-7.97(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-[3-bromo-5-chloro-2-(difluoromethoxy)phenyl]cyclopent-2-ene-1-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3CC(C=C3)N

DOS

IR

Vibrations