Geometry & MOs

Info

ID:	79466
PubChem CID:	49754990
Reduced:	N3O4C22H27 (1)
Stoich.:	A3B4C22D27 (1)
Weight, g/mol:	361.146013
ΔH_f, kcal/mol:	-81.67
Dipole, Da:	6.04
IP(EA), eV:	-9.14(-0.09)
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-thiophen-3-ylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)C(=O)N2CCC(CC2)CNC(=O)C3(CC3)C4=CC=CC=C4OC

DOS

IR

Vibrations