Geometry & MOs

Info

ID:	38153
PubChem CID:	8027446
Reduced:	NSO2C9H13 (1)
Stoich.:	ABC2D9E13 (1)
Weight, g/mol:	311.115758
ΔH_f, kcal/mol:	-71.22
Dipole, Da:	2.38
IP(EA), eV:	-8.87(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(3-methoxynaphthalene-2-carbonyl)-2-oxopiperidine-1-carbaldehyde

Drug info:

PubChemData

Smile

CSCC(=O)[C@@H]1CCN(C1=O)C=C

DOS

IR

Vibrations