Geometry & MOs

Info

ID:	361243
PubChem CID:	127302407
Reduced:	N3O4C20H29 (1)
Stoich.:	A3B4C20D29 (1)
Weight, g/mol:	394.294391
ΔH_f, kcal/mol:	-171.17
Dipole, Da:	4.82
IP(EA), eV:	-8.4(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-3-methyl-1-[4-(morpholin-4-ylmethyl)piperidin-1-yl]-1-oxopentan-2-yl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CCC(C)[C@@H](C(=O)NC1=CC2=C(C=C1)OC(O2)(C)C)NC(=O)N3CCCC3

DOS

IR

Vibrations