Geometry & MOs

Info

ID:	413380
PubChem CID:	135086329
Reduced:	BrSiN2O3C12H21 (1)
Stoich.:	ABC2D3E12F21 (1)
Weight, g/mol:	207.104799
ΔH_f, kcal/mol:	-140.33
Dipole, Da:	4.7
IP(EA), eV:	-9.79(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-isocyano-4-methyl-2-(4-methylphenyl)benzene

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN(N=C1Br)COCC[Si](C)(C)C

DOS

IR

Vibrations