Geometry & MOs

Info

ID:	423887
PubChem CID:	135120633
Reduced:	NOC20H31 (1)
Stoich.:	ABC20D31 (1)
Weight, g/mol:	316.215078
ΔH_f, kcal/mol:	-51.28
Dipole, Da:	2.49
IP(EA), eV:	-8.43(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5R)-N-(2-ethylphenyl)-4-methoxy-7-azaspiro[4.5]decane-7-carboxamide

Drug info:

PubChemData

Smile

CO[C@@H]1CCC[C@@]12CCCN(C2)CCCCC3=CC=CC=C3

DOS

IR

Vibrations