Geometry & MOs

Info

ID:	370494
PubChem CID:	127339032
Reduced:	SN3O4C16H21 (1)
Stoich.:	AB3C4D16E21 (1)
Weight, g/mol:	382.236876
ΔH_f, kcal/mol:	-137.29
Dipole, Da:	8.42
IP(EA), eV:	-9.68(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(2-methoxyphenyl)pyrrolidin-1-yl]-[1-[(1-methylimidazol-2-yl)methyl]piperidin-4-yl]methanone

Drug info:

PubChemData

Smile

CN1CCC(C1=O)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

DOS

IR

Vibrations