Geometry & MOs

Info

ID:	405716
PubChem CID:	135075153
Reduced:	ClSiN2C16H21 (1)
Stoich.:	ABC2D16E21 (1)
Weight, g/mol:	252.064726
ΔH_f, kcal/mol:	11.91
Dipole, Da:	3.15
IP(EA), eV:	-9.17(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-nitrophenyl)-1,2,4-benzotriazine

Drug info:

PubChemData

Smile

CC(C)[Si](C1=CC=C(C=C1)Cl)(C2=NC=CC=N2)C(C)C

DOS

IR

Vibrations