Geometry & MOs

Info

ID:	313288
PubChem CID:	126613605
Reduced:	ClN3C27H30 (1)
Stoich.:	AB3C27D30 (1)
Weight, g/mol:	334.240899
ΔH_f, kcal/mol:	63.65
Dipole, Da:	4.87
IP(EA), eV:	-8.71(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N,5-N-bis(2,6-dimethylphenyl)heptane-3,5-diimine

Drug info:

PubChemData

Smile

CC(C)C1=C(C(=CC=C1)C(C)C)N=C(C)C2=CC=CC(=N2)C(=NC3=CC=C(C=C3)Cl)C

DOS

IR

Vibrations