Geometry & MOs

Info

ID:	14022
PubChem CID:	401580
Reduced:	ON2H12C14 (1)
Stoich.:	AB2C12D14 (1)
Weight, g/mol:	224.094963
ΔH_f, kcal/mol:	36.55
Dipole, Da:	4.05
IP(EA), eV:	-8.38(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,3-benzoxazol-2-yl)-N-methylaniline

Drug info:

PubChemData

Smile

CNC1=CC=C(C=C1)C2=NC3=CC=CC=C3O2

DOS

IR

Vibrations