Geometry & MOs

Info

ID:	303646
PubChem CID:	124489996
Reduced:	NOH25C28 (1)
Stoich.:	ABC25D28 (1)
Weight, g/mol:	430.204513
ΔH_f, kcal/mol:	45.81
Dipole, Da:	2.23
IP(EA), eV:	-8.36(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,3S)-2'-methyl-1-phenylspiro[1,2-dihydrobenzo[f]chromene-3,1'-4,9-dihydro-3H-pyrido[3,4-b]indole]

Drug info:

PubChemData

Smile

CN1CCC2=CC=CC=C2[C@]13C[C@@H](C4=C(O3)C=CC5=CC=CC=C54)C6=CC=CC=C6

DOS

IR

Vibrations