Geometry & MOs

Info

ID:	24899
PubChem CID:	614294
Reduced:	ON2C18H20 (1)
Stoich.:	AB2C18D20 (1)
Weight, g/mol:	280.157563
ΔH_f, kcal/mol:	12.67
Dipole, Da:	3.08
IP(EA), eV:	-8.19(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-N-phenyl-2H-1,4-benzoxazin-3-amine

Drug info:

PubChemData

Smile

CC(C)(C)C1C(=NC2=CC=CC=C2O1)NC3=CC=CC=C3

DOS

IR

Vibrations