Geometry & MOs

Info

ID:	420697
PubChem CID:	135114677
Reduced:	ON3C9H12 (2)
Stoich.:	AB3C9D12 (2)
Weight, g/mol:	273.184112
ΔH_f, kcal/mol:	-25.02
Dipole, Da:	4.0
IP(EA), eV:	-8.61(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-methyl-1-oxa-9-azaspiro[5.5]undec-4-en-9-yl)methyl]pyridin-2-amine

Drug info:

PubChemData

Smile

C1COCCN1C2=NC(=CC(=N2)N3C[C@H]([C@@H](C3)O)CC4=CC=CC=N4)N

DOS

IR

Vibrations