Geometry & MOs

Info

ID:	278496
PubChem CID:	103836301
Reduced:	SN3O4C11H15 (1)
Stoich.:	AB3C4D11E15 (1)
Weight, g/mol:	283.158372
ΔH_f, kcal/mol:	-78.23
Dipole, Da:	2.95
IP(EA), eV:	-10.21(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[(2-fluorophenyl)methyl]-3-hydroxypropyl]carbamate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NN=C1)S(=O)(=O)NCCCC#C

DOS

IR

Vibrations