Geometry & MOs

Info

ID:	55845
PubChem CID:	17396654
Reduced:	N3O4C19H21 (1)
Stoich.:	A3B4C19D21 (1)
Weight, g/mol:	368.137222
ΔH_f, kcal/mol:	-60.79
Dipole, Da:	0.77
IP(EA), eV:	-9.34(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[2-(2-acetylanilino)-2-oxoethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxylate

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C

DOS

IR

Vibrations