Geometry & MOs

Info

ID:	399734
PubChem CID:	135042114
Reduced:	NOCl3C9H12 (1)
Stoich.:	ABC3D9E12 (1)
Weight, g/mol:	223.099714
ΔH_f, kcal/mol:	-62.24
Dipole, Da:	4.82
IP(EA), eV:	-10.14(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopropyl-(2-pyridin-2-ylphenyl)methanone

Drug info:

PubChemData

Smile

C1CC[C@@H](C=CC1)NC(=O)C(Cl)(Cl)Cl

DOS

IR

Vibrations