Geometry & MOs

Info

ID:	203951
PubChem CID:	79893430
Reduced:	ON2C7H9 (2)
Stoich.:	AB2C7D9 (2)
Weight, g/mol:	244.096026
ΔH_f, kcal/mol:	-38.45
Dipole, Da:	1.68
IP(EA), eV:	-8.24(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-1,3-benzoxazole-2,6-diamine

Drug info:

PubChemData

Smile

CC(=O)N1CCCN(CC1)C2=NC3=C(C=CC=C3O2)N

DOS

IR

Vibrations