Geometry & MOs

Info

ID:	420316
PubChem CID:	135112403
Reduced:	N2O3C18H20 (1)
Stoich.:	A2B3C18D20 (1)
Weight, g/mol:	331.214744
ΔH_f, kcal/mol:	-88.08
Dipole, Da:	6.21
IP(EA), eV:	-8.53(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]-3-(4-methoxyphenyl)propan-1-one

Drug info:

PubChemData

Smile

CC1=CC(=C(N=C1C)CCC2COC3=CC=CC=C3O2)C(=O)N

DOS

IR

Vibrations