Geometry & MOs

Info

ID:	358784
PubChem CID:	127296650
Reduced:	NSO2C14H17 (1)
Stoich.:	ABC2D14E17 (1)
Weight, g/mol:	364.178693
ΔH_f, kcal/mol:	-55.27
Dipole, Da:	4.04
IP(EA), eV:	-9.26(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(1-hydroxynaphthalene-2-carbonyl)pyrrolidin-2-yl]-(4-methylidenepiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

C=C1CCN(CC1)C(=O)C2=CC3=C(S2)CCOC3

DOS

IR

Vibrations