Geometry & MOs

Info

ID:	303645
PubChem CID:	124489995
Reduced:	NOH25C28 (1)
Stoich.:	ABC25D28 (1)
Weight, g/mol:	391.193614
ΔH_f, kcal/mol:	110.32
Dipole, Da:	4.03
IP(EA), eV:	-8.04(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,3R)-2'-methyl-1-phenylspiro[1,2-dihydrobenzo[f]chromene-3,1'-3,4-dihydroisoquinoline]

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