Geometry & MOs

Info

ID:	429145
PubChem CID:	135168933
Reduced:	N3H51C80 (1)
Stoich.:	A3B51C80 (1)
Weight, g/mol:	509.21435
ΔH_f, kcal/mol:	359.37
Dipole, Da:	1.15
IP(EA), eV:	-7.94(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(9,9-diphenylfluoren-2-yl)phenanthren-2-amine

Drug info:

Smile

C1=CC=C(C=C1)C2(C3=CC=CC=C3C4=C2C=C(C=C4)N(C5=CC=C(C=C5)C6=CC(=CC=C6)N7C8=CC=CC=C8C9=CC=CC=C97)C1=CC2=C(C=C1)C1=CC=CC=C1C21C2=CC=CC=C2N2C3=CC=CC=C3C3=C2C1=CC=C3)C1=CC=CC=C1

DOS

IR

Vibrations