Geometry & MOs

Info

ID:	317130
PubChem CID:	126632585
Reduced:	N2H20C29 (1)
Stoich.:	A2B20C29 (1)
Weight, g/mol:	396.162649
ΔH_f, kcal/mol:	128.43
Dipole, Da:	1.44
IP(EA), eV:	-7.7(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

12-methyl-15-phenyl-12,15-diazahexacyclo[11.11.0.02,11.03,8.014,22.016,21]tetracosa-1(13),2(11),3,5,7,9,14(22),16,18,20,23-undecaene

Drug info:

PubChemData

Smile

CN1C2=C(C3=CC=CC=C3C=C2)C4=C1C=C5C6=CC=CC=C6N(C5=C4)C7=CC=CC=C7

DOS

IR

Vibrations