Geometry & MOs

Info

ID:	344083
PubChem CID:	127267259
Reduced:	FO2N4C16H21 (1)
Stoich.:	AB2C4D16E21 (1)
Weight, g/mol:	333.18009
ΔH_f, kcal/mol:	-104.82
Dipole, Da:	2.16
IP(EA), eV:	-9.3(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3,3-dimethyl-4-oxoazetidin-2-yl)-N-(6-methoxypyrimidin-4-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(C(NC1=O)C2CCN(CC2)C(=O)NC3=NC=C(C=C3)F)C

DOS

IR

Vibrations