Geometry & MOs

Info

ID:	396358
PubChem CID:	135028205
Reduced:	SiO4C37H50 (1)
Stoich.:	AB4C37D50 (1)
Weight, g/mol:	347.236148
ΔH_f, kcal/mol:	-195.74
Dipole, Da:	3.59
IP(EA), eV:	-8.84(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-tert-butylphenyl)-2-[(2E)-2-[(4-tert-butylphenyl)methylidene]hydrazinyl]acetonitrile

Drug info:

PubChemData

Smile

C[C@H]1[C@@H](O[C@]2(CCC1O2)C)[C@H](C)[C@@H]([C@H](C)CO[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C)OCC5=CC=CC=C5

DOS

IR

Vibrations