Geometry & MOs

Info

ID:	331252
PubChem CID:	127248659
Reduced:	FO2N4C24H25 (1)
Stoich.:	AB2C4D24E25 (1)
Weight, g/mol:	432.216141
ΔH_f, kcal/mol:	-41.97
Dipole, Da:	4.96
IP(EA), eV:	-8.94(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[2-(dimethylamino)-5-(3-methoxyphenyl)pyrimidin-4-yl]pyrrolidin-1-yl]-(2-methoxyphenyl)methanone

Drug info:

PubChemData

Smile

CN(C)C1=NC=C(C(=N1)C2CCN(C2)C(=O)C3=CC=CC=C3OC)C4=CC=C(C=C4)F

DOS

IR

Vibrations