Geometry & MOs

Info

ID:	12850
PubChem CID:	146866
Reduced:	ON6H18C23 (1)
Stoich.:	AB6C18D23 (1)
Weight, g/mol:	394.154209
ΔH_f, kcal/mol:	146.26
Dipole, Da:	7.17
IP(EA), eV:	-7.92(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[10-amino-14-(dimethylamino)-8,13,15-triazatetracyclo[7.6.0.02,7.011,15]pentadeca-1,3,5,7,9,11,13-heptaen-12-yl]-(1H-indol-3-yl)methanone

Drug info:

PubChemData

Smile

CN(C)C1=NC(=C2N1C3=C4C=CC=CC4=NC3=C2N)C(=O)C5=CNC6=CC=CC=C65

DOS

IR

Vibrations