Geometry & MOs

Info

ID:	373175
PubChem CID:	131311111
Reduced:	O2N3C11H17 (1)
Stoich.:	A2B3C11D17 (1)
Weight, g/mol:	211.003621
ΔH_f, kcal/mol:	-62.83
Dipole, Da:	4.37
IP(EA), eV:	-9.37(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-hydroxy-3-methoxybenzoyl cyanide

Drug info:

PubChemData

Smile

CN(CC1(CCNC1)O)C(=O)C2=CC=CN2

DOS

IR

Vibrations