Geometry & MOs

Info

ID:	214651
PubChem CID:	85083342
Reduced:	N4O7C30H38 (1)
Stoich.:	A4B7C30D38 (1)
Weight, g/mol:	566.208673
ΔH_f, kcal/mol:	-223.1
Dipole, Da:	7.03
IP(EA), eV:	-8.8(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl N-[4-[benzenesulfonyl(benzyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate

Drug info:

PubChemData

Smile

COC1C(C(OC(C1O)COCC2=CC3=CC=CC=C3C=C2)OCC4=CC(=CC=C4)O)NC(=O)CCCN=C(N)N

DOS

IR

Vibrations