Geometry & MOs

Info

ID:	130493
PubChem CID:	51090958
Reduced:	SN3O3C15H23 (1)
Stoich.:	AB3C3D15E23 (1)
Weight, g/mol:	316.178693
ΔH_f, kcal/mol:	-139.34
Dipole, Da:	4.77
IP(EA), eV:	-9.13(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dihydro-2H-chromen-3-yl)-1-propanoylpiperidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C

DOS

IR

Vibrations