Geometry & MOs

Info

ID:	203919
PubChem CID:	79891051
Reduced:	O2N3C11H15 (1)
Stoich.:	A2B3C11D15 (1)
Weight, g/mol:	267.137162
ΔH_f, kcal/mol:	-53.47
Dipole, Da:	4.14
IP(EA), eV:	-8.29(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-methyl-2-N-(2-phenylethyl)-1,3-benzoxazole-2,5-diamine

Drug info:

PubChemData

Smile

CC(C)(CNC1=NC2=C(O1)C=CC(=C2)N)O

DOS

IR

Vibrations