Geometry & MOs

Info

ID:	389853
PubChem CID:	134995587
Reduced:	NO3C8H17 (1)
Stoich.:	AB3C8D17 (1)
Weight, g/mol:	180.089878
ΔH_f, kcal/mol:	-99.28
Dipole, Da:	3.95
IP(EA), eV:	-10.6(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methylimino-[(4-methylphenyl)methoxy]-oxidoazanium

Drug info:

PubChemData

Smile

CC(C)(CC(C)(C)O)C[N+](=O)[O-]

DOS

IR

Vibrations