Geometry & MOs

Info

ID:	182904
PubChem CID:	76953024
Reduced:	N3O3C8H17 (1)
Stoich.:	A3B3C8D17 (1)
Weight, g/mol:	279.158292
ΔH_f, kcal/mol:	-114.85
Dipole, Da:	3.44
IP(EA), eV:	-9.24(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-(3-amino-3-hydroxyiminopropyl)-N-phenylcarbamate

Drug info:

PubChemData

Smile

CC(C)COC(=O)NCCC(=NO)N

DOS

IR

Vibrations