Geometry & MOs

Info

ID:	34201
PubChem CID:	7890268
Reduced:	N3O4C16H17 (1)
Stoich.:	A3B4C16D17 (1)
Weight, g/mol:	296.0007
ΔH_f, kcal/mol:	-62.6
Dipole, Da:	4.52
IP(EA), eV:	-8.95(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,6-dichlorophenyl)methyl 3-hydroxybenzoate

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)NC(=O)CN2C=C(C=CC2=O)[N+](=O)[O-]

DOS

IR

Vibrations