Geometry & MOs

Info

ID:	419853
PubChem CID:	135109414
Reduced:	O3N5C18H27 (1)
Stoich.:	A3B5C18D27 (1)
Weight, g/mol:	379.189592
ΔH_f, kcal/mol:	-28.28
Dipole, Da:	8.47
IP(EA), eV:	-9.0(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-propan-2-yl-1,3-oxazol-4-yl)-spiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-ylmethanone

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=CC(=NC=N2)N3C[C@H]4CN([C@@H](C3)COC4)CC(=O)O

DOS

IR

Vibrations