Geometry & MOs

Info

ID:	295507
PubChem CID:	117531623
Reduced:	N2O3C11H12 (1)
Stoich.:	A2B3C11D12 (1)
Weight, g/mol:	250.095357
ΔH_f, kcal/mol:	-71.51
Dipole, Da:	2.82
IP(EA), eV:	-9.01(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,5-dimethoxyphenyl)methyl N-(cyanomethyl)carbamate

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)COC(=O)NCC#N

DOS

IR

Vibrations