Geometry & MOs

Info

ID:	244037
PubChem CID:	99309430
Reduced:	SN4O5C21H28 (1)
Stoich.:	AB4C5D21E28 (1)
Weight, g/mol:	424.236208
ΔH_f, kcal/mol:	-174.02
Dipole, Da:	4.27
IP(EA), eV:	-9.09(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]-3-[5-[(1R,2R)-2-methylcyclopropyl]furan-2-yl]propanamide

Drug info:

PubChemData

Smile

CNS(=O)(=O)C1=CN(C(=C1)C(=O)NC2CCN(CC2)C(=O)CC3=CC(=CC=C3)OC)C

DOS

IR

Vibrations