Geometry & MOs

Info

ID:	437626
PubChem CID:	135226733
Reduced:	NC11H19 (1)
Stoich.:	AB11C19 (1)
Weight, g/mol:	423.03428
ΔH_f, kcal/mol:	-13.22
Dipole, Da:	1.62
IP(EA), eV:	-8.53(1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(2R)-1-(2-fluoro-4-iodophenyl)-2-formyl-3-hydroxypropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1=CCC2C(C1)CCCN2C

DOS

IR

Vibrations