Geometry & MOs

Info

ID:	143125
PubChem CID:	53150080
Reduced:	SN2O3C23H28 (1)
Stoich.:	AB2C3D23E28 (1)
Weight, g/mol:	436.236208
ΔH_f, kcal/mol:	-94.31
Dipole, Da:	4.04
IP(EA), eV:	-9.18(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[[1-(4-methoxy-2-methylbenzoyl)piperidin-3-yl]methoxy]phenyl]-pyrrolidin-1-ylmethanone

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C(=O)N2CCCC(C2)COC3=CC=C(C=C3)C(=O)N4CCCC4

DOS

IR

Vibrations