Geometry & MOs

Info

ID:	401577
PubChem CID:	135051678
Reduced:	FeOPC12H13 (1)
Stoich.:	ABCD12E13 (1)
Weight, g/mol:	306.139969
ΔH_f, kcal/mol:	118.87
Dipole, Da:	10.6
IP(EA), eV:	-7.64(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyanomethyl)-4,5-dimethoxyphenyl]-N-trimethylsilylacetamide

Drug info:

PubChemData

Smile

C[C]1[CH][P][C]([C]1C)C=O.[CH]1[CH][CH][CH][CH]1.[Fe]

DOS

IR

Vibrations