Geometry & MOs

Info

ID:	191806
PubChem CID:	78188835
Reduced:	SF2N2O6C25H32 (1)
Stoich.:	AB2C2D6E25F32 (1)
Weight, g/mol:	550.234887
ΔH_f, kcal/mol:	-321.3
Dipole, Da:	2.39
IP(EA), eV:	-9.6(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

oxolan-3-yl N-[4-[(3,4-dimethoxyphenyl)sulfonyl-(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)OC2CCOC2)O)S(=O)(=O)C3=CC(=C(C=C3)F)F

DOS

IR

Vibrations