Geometry & MOs

Info

ID:	265908
PubChem CID:	103556347
Reduced:	NOC17H31 (1)
Stoich.:	ABC17D31 (1)
Weight, g/mol:	276.147393
ΔH_f, kcal/mol:	-60.97
Dipole, Da:	1.42
IP(EA), eV:	-8.82(1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[1-amino-2-(1-methoxycyclobutyl)ethyl]-3-methyl-1,3-benzoxazol-2-one

Drug info:

PubChemData

Smile

CCCNC(CC1(CCC1)OC)C2=CCCCCC2

DOS

IR

Vibrations