Geometry & MOs

Info

ID:	271184
PubChem CID:	103646866
Reduced:	BrN2O2C14H19 (1)
Stoich.:	AB2C2D14E19 (1)
Weight, g/mol:	317.173942
ΔH_f, kcal/mol:	-67.89
Dipole, Da:	2.89
IP(EA), eV:	-8.86(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]phenyl]carbamate

Drug info:

PubChemData

Smile

CN1CCC(C1)CN(C)C(=O)C2=C(C=CC(=C2)Br)O

DOS

IR

Vibrations