Geometry & MOs

Info

ID:	403626
PubChem CID:	135061073
Reduced:	N2C27H28 (1)
Stoich.:	A2B27C28 (1)
Weight, g/mol:	412.215078
ΔH_f, kcal/mol:	68.93
Dipole, Da:	3.89
IP(EA), eV:	-7.83(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11,13-bis(4-methoxyphenyl)-13-methyl-1,10-diazatricyclo[7.4.1.05,14]tetradeca-5(14),6,8,10-tetraene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NC3=CC=CC4=C3N(CCC4)C(C2)(C)C5=CC=C(C=C5)C

DOS

IR

Vibrations