Geometry & MOs

Info

ID:	365348
PubChem CID:	127317747
Reduced:	O2N4C19H26 (1)
Stoich.:	A2B4C19D26 (1)
Weight, g/mol:	319.153206
ΔH_f, kcal/mol:	-56.68
Dipole, Da:	5.63
IP(EA), eV:	-8.75(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-3-[(3-methyloxolan-3-yl)methyl]urea

Drug info:

PubChemData

Smile

C1CC(C1)N2CCN(CC2)C(=O)NC3=CC=CC=C3N4CCCC4=O

DOS

IR

Vibrations