Geometry & MOs

Info

ID:	264222
PubChem CID:	103443357
Reduced:	ClNOC14H18 (1)
Stoich.:	ABCD14E18 (1)
Weight, g/mol:	199.040006
ΔH_f, kcal/mol:	-38.5
Dipole, Da:	3.73
IP(EA), eV:	-9.93(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloropyridin-2-yl)-2-ethoxyethanone

Drug info:

PubChemData

Smile

CCC1CCCC(C1)C(=O)C2=C(C=CC=N2)Cl

DOS

IR

Vibrations