Geometry & MOs

Info

ID:	440283
PubChem CID:	135230230
Reduced:	O2N3H11C16 (1)
Stoich.:	A2B3C11D16 (1)
Weight, g/mol:	245.189198
ΔH_f, kcal/mol:	56.38
Dipole, Da:	2.67
IP(EA), eV:	-9.22(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-N-[2-[(Z)-2-iminoethylideneamino]propan-2-yl]aniline

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)C3=NN=C(O3)/C=C(/CO)\C#N

DOS

IR

Vibrations