Geometry & MOs

Info

ID:	47978
PubChem CID:	10536111
Reduced:	O2C13H14 (1)
Stoich.:	A2B13C14 (1)
Weight, g/mol:	202.110613
ΔH_f, kcal/mol:	-23.67
Dipole, Da:	1.75
IP(EA), eV:	-9.69(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-propan-2-yl-3,1-benzoxazin-4-imine

Drug info:

PubChemData

Smile

CCOC(=O)C(CC#C)C1=CC=CC=C1

DOS

IR

Vibrations