Geometry & MOs

Info

ID:	391057
PubChem CID:	135002546
Reduced:	NO2C24H31 (1)
Stoich.:	AB2C24D31 (1)
Weight, g/mol:	437.221561
ΔH_f, kcal/mol:	-62.36
Dipole, Da:	3.67
IP(EA), eV:	-8.9(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,10bS)-1-(4-morpholin-4-ylphenyl)imino-3-propan-2-yl-3,10b-dihydropyrrolo[2,1-a]isoquinoline-2,2-dicarbonitrile

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C(=NC(C)(C)CC(C)(C)C)OC2C3=CC=C(C=C3)OC

DOS

IR

Vibrations