Geometry & MOs

Info

ID:	12119
PubChem CID:	130600
Reduced:	NOC6H11 (1)
Stoich.:	ABC6D11 (1)
Weight, g/mol:	113.084064
ΔH_f, kcal/mol:	-13.29
Dipole, Da:	3.42
IP(EA), eV:	-10.21(1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-isocyano-2-methoxy-2-methylpropane

Drug info:

PubChemData

Smile

CC(C)(C[N+]#[C-])OC

DOS

IR

Vibrations