Geometry & MOs

Info

ID:	350162
PubChem CID:	127277240
Reduced:	O3N4C19H26 (1)
Stoich.:	A3B4C19D26 (1)
Weight, g/mol:	355.200825
ΔH_f, kcal/mol:	-84.37
Dipole, Da:	2.7
IP(EA), eV:	-8.15(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(dimethylamino)methyl]-N-[4-(2-methyl-4-oxo-1H-pyrimidin-6-yl)phenyl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

C1COCCN1CCN2C=CC3=C2C=CC(=C3)NC(=O)N4CCOCC4

DOS

IR

Vibrations