Geometry & MOs

Info

ID:	329737
PubChem CID:	127246604
Reduced:	N3O3C18H19 (1)
Stoich.:	A3B3C18D19 (1)
Weight, g/mol:	325.153875
ΔH_f, kcal/mol:	-57.72
Dipole, Da:	4.93
IP(EA), eV:	-8.8(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[3-(4-methylpyrimidin-2-yl)pyrrolidine-1-carbonyl]pyridin-2-yl]acetamide

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1)C2CCN(C2)C(=O)C3=C4C(=CC=C3)OCCO4

DOS

IR

Vibrations