Geometry & MOs

Info

ID:	430230
PubChem CID:	135170294
Reduced:	NC54H59 (1)
Stoich.:	AB54C59 (1)
Weight, g/mol:	615.480401
ΔH_f, kcal/mol:	60.86
Dipole, Da:	0.99
IP(EA), eV:	-7.88(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC(=CC4=C3C5=C(C46C7=C(C=CC(=C7)C(C)(C)C)C8=C6C=C(C=C8)C(C)(C)C)C=C(C=C5)C(C)(C)C)C(C)(C)C

DOS

IR

Vibrations