Geometry & MOs

Info

ID:	379208
PubChem CID:	134356757
Reduced:	N2O3C12H24 (1)
Stoich.:	A2B3C12D24 (1)
Weight, g/mol:	517.213675
ΔH_f, kcal/mol:	-180.75
Dipole, Da:	4.59
IP(EA), eV:	-9.88(0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(5S)-5-[(3-azidobenzoyl)amino]-7-(2,6-difluorophenoxy)-6-oxoheptyl]carbamate

Drug info:

PubChemData

Smile

CC(CCCCNC(=O)OC(C)(C)C)NC=O

DOS

IR

Vibrations