Geometry & MOs

Info

ID:	192295
PubChem CID:	78254277
Reduced:	N2O4C27H38 (1)
Stoich.:	A2B4C27D38 (1)
Weight, g/mol:	366.194343
ΔH_f, kcal/mol:	-150.87
Dipole, Da:	2.02
IP(EA), eV:	-8.67(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCOC1=CC=CC(=C1)C2C3=C(C(=O)N2CCCN(CC)CC)OC4CCCCC4C3=O

DOS

IR

Vibrations