Geometry & MOs

Info

ID:	78420
PubChem CID:	49689571
Reduced:	SN3O3C20H25 (1)
Stoich.:	AB3C3D20E25 (1)
Weight, g/mol:	387.161663
ΔH_f, kcal/mol:	-60.73
Dipole, Da:	5.76
IP(EA), eV:	-8.9(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]methyl]-3-phenylsulfanylpropanamide

Drug info:

PubChemData

Smile

CCSC1=CC=CC=C1C(=O)NCC2CCN(CC2)C(=O)C3=NOC(=C3)C

DOS

IR

Vibrations