Geometry & MOs

Info

ID:	48072
PubChem CID:	10536979
Reduced:	ClNO2H8C11 (1)
Stoich.:	ABC2D8E11 (1)
Weight, g/mol:	221.03559
ΔH_f, kcal/mol:	-26.9
Dipole, Da:	4.63
IP(EA), eV:	-9.24(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-2-azido-3-chloro-3-(3-methylphenyl)prop-2-enal

Drug info:

PubChemData

Smile

CC1=CC(=NC2=CC=C(C=C2)Cl)OC1=O

DOS

IR

Vibrations