Geometry & MOs

Info

ID:	197389
PubChem CID:	78961653
Reduced:	OSN4C14H18 (1)
Stoich.:	ABC4D14E18 (1)
Weight, g/mol:	257.116427
ΔH_f, kcal/mol:	51.88
Dipole, Da:	3.55
IP(EA), eV:	-8.67(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1,3-benzoxazol-2-amine

Drug info:

PubChemData

Smile

CC1=C(N2C=CSC2=N1)CNC(C)C3=C(ON=C3C)C

DOS

IR

Vibrations