Geometry & MOs

Info

ID:	371297
PubChem CID:	127345557
Reduced:	N2O3C12H20 (1)
Stoich.:	A2B3C12D20 (1)
Weight, g/mol:	353.148789
ΔH_f, kcal/mol:	-122.51
Dipole, Da:	3.45
IP(EA), eV:	-9.6(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-2-pyrrolidin-1-ylpyrimidine-4-carboxamide

Drug info:

PubChemData

Smile

CN(CC(=O)NC1CC1)C(=O)CC2CCOC2

DOS

IR

Vibrations