Geometry & MOs

Info

ID:	299077
PubChem CID:	117670544
Reduced:	NOC10H15 (2)
Stoich.:	ABC10D15 (2)
Weight, g/mol:	575.2613
ΔH_f, kcal/mol:	-39.15
Dipole, Da:	4.51
IP(EA), eV:	-9.34(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

18-(7-tert-butylphenanthren-2-yl)-10-phenyl-10-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,14,16(21),17,19-decaene

Drug info:

PubChemData

Smile

C1=CC(C=C1)CN(CC2C=CC=C2)CC(=O)NCCCCCCO

DOS

IR

Vibrations