Geometry & MOs

Info

ID:	285789
PubChem CID:	104132089
Reduced:	ON2C16H26 (1)
Stoich.:	AB2C16D26 (1)
Weight, g/mol:	225.055656
ΔH_f, kcal/mol:	-39.19
Dipole, Da:	2.31
IP(EA), eV:	-8.95(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopropylmethyl 2-chloro-6-methylpyridine-4-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)OCCCC=C)CNC(C)(C)C

DOS

IR

Vibrations