Geometry & MOs

Info

ID:	395641
PubChem CID:	135026072
Reduced:	NOC8H8 (2)
Stoich.:	ABC8D8 (2)
Weight, g/mol:	241.107593
ΔH_f, kcal/mol:	-7.13
Dipole, Da:	5.26
IP(EA), eV:	-9.05(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-tri(pyrazol-1-yl)ethanimine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1C=CC(=C1)C2=CC=CC=C2[N+]#[C-]

DOS

IR

Vibrations