Geometry & MOs

Info

ID:	329298
PubChem CID:	126734348
Reduced:	NO3C7H11 (1)
Stoich.:	AB3C7D11 (1)
Weight, g/mol:	600.261771
ΔH_f, kcal/mol:	-125.15
Dipole, Da:	4.39
IP(EA), eV:	-9.92(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dioxatricyclo[4.3.1.03,8]decan-10-yl N-[(2S,3R)-4-[(4-aminophenyl)sulfonyl-[(1-methylazetidin-3-yl)methyl]amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)C1=C(C(=O)NC1O)O

DOS

IR

Vibrations