Geometry & MOs

Info

ID:	362867
PubChem CID:	127309696
Reduced:	N3O3C19H29 (1)
Stoich.:	A3B3C19D29 (1)
Weight, g/mol:	390.226705
ΔH_f, kcal/mol:	-106.29
Dipole, Da:	3.72
IP(EA), eV:	-8.84(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-hydroxybenzoyl)-N-[[1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

COCCN1CCCC1CNC(=O)N2CCOC(C2)C3=CC=CC=C3

DOS

IR

Vibrations