Geometry & MOs

Info

ID:	76113
PubChem CID:	48424456
Reduced:	SN3O3C18H23 (1)
Stoich.:	AB3C3D18E23 (1)
Weight, g/mol:	326.220557
ΔH_f, kcal/mol:	-106.95
Dipole, Da:	2.89
IP(EA), eV:	-9.18(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(cyclopropylmethoxy)propanoyl]-N-(3-methoxypropyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C)C(C)NC(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations