Geometry & MOs

Info

ID:	48050
PubChem CID:	10536794
Reduced:	NOC6H7 (2)
Stoich.:	ABC6D7 (2)
Weight, g/mol:	218.116761
ΔH_f, kcal/mol:	-42.62
Dipole, Da:	3.25
IP(EA), eV:	-9.14(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butylimino-[4-(diazomethyl)phenyl]-oxidoazanium

Drug info:

PubChemData

Smile

CC(C)(C)N1C(=O)OC(=N1)C2=CC=CC=C2

DOS

IR

Vibrations