Geometry & MOs

Info

ID:	157605
PubChem CID:	56436004
Reduced:	O2S2N3C20H27 (1)
Stoich.:	A2B2C3D20E27 (1)
Weight, g/mol:	374.220557
ΔH_f, kcal/mol:	-54.22
Dipole, Da:	7.38
IP(EA), eV:	-9.17(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(1,3-dioxolan-2-yl)piperidin-1-yl]-2-oxo-1-phenylethyl]-3-methylbutanamide

Drug info:

PubChemData

Smile

CCCCCCNC(=O)C1CCCN(C1)C(=O)C2=CN=C(S2)C3=CC=CS3

DOS

IR

Vibrations