Geometry & MOs

Info

ID:	276267
PubChem CID:	103821841
Reduced:	N3O3C17H27 (1)
Stoich.:	A3B3C17D27 (1)
Weight, g/mol:	307.153206
ΔH_f, kcal/mol:	-151.28
Dipole, Da:	6.15
IP(EA), eV:	-8.34(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[(2-oxo-3H-1,3-benzoxazol-5-yl)amino]propyl]carbamate

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)NC)NCCCNC(=O)OC(C)(C)C

DOS

IR

Vibrations