Geometry & MOs

Info

ID:	51246
PubChem CID:	12013888
Reduced:	NO3H13C15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	275.034921
ΔH_f, kcal/mol:	-66.99
Dipole, Da:	5.96
IP(EA), eV:	-9.79(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-chlorobenzoyl)-3,4-dihydropyrrolo[2,1-c][1,4]oxazin-1-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)C2=CC=C3N2CCOC3=O

DOS

IR

Vibrations