Geometry & MOs

Info

ID:	192411
PubChem CID:	78266709
Reduced:	BrON2H15C17 (1)
Stoich.:	ABC2D15E17 (1)
Weight, g/mol:	384.08373
ΔH_f, kcal/mol:	43.67
Dipole, Da:	2.19
IP(EA), eV:	-8.86(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-bromophenyl)-2-(2-methylpropyl)-5,10b-dihydro-3H-pyrazolo[1,5-c][1,3]benzoxazine

Drug info:

PubChemData

Smile

CC(=O)N1C(C=C(N1)C2=CC=C(C=C2)Br)C3=CC=CC=C3

DOS

IR

Vibrations