Geometry & MOs

Info

ID:	235170
PubChem CID:	92304172
Reduced:	N3O4C23H27 (1)
Stoich.:	A3B4C23D27 (1)
Weight, g/mol:	409.200156
ΔH_f, kcal/mol:	-125.17
Dipole, Da:	6.08
IP(EA), eV:	-9.3(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-4-(3-methoxybenzoyl)-N-(pyridin-2-ylmethyl)-1-oxa-4-azaspiro[4.5]decane-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)C(=O)N2[C@@H](COC23CCCCC3)C(=O)NCC4=CC=CC=N4

DOS

IR

Vibrations