Geometry & MOs

Info

ID:	417655
PubChem CID:	135102395
Reduced:	N3O3C15H17 (1)
Stoich.:	A3B3C15D17 (1)
Weight, g/mol:	251.188529
ΔH_f, kcal/mol:	-45.64
Dipole, Da:	5.36
IP(EA), eV:	-8.88(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4R,5R)-4-methoxy-7-azaspiro[4.5]decan-7-yl]-(1-methylcyclopropyl)methanone

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=C(C=NN2)CN3CC(C3)C(=O)O

DOS

IR

Vibrations