Geometry & MOs

Info

ID:	44132
PubChem CID:	10500982
Reduced:	N3O3H19C24 (1)
Stoich.:	A3B3C19D24 (1)
Weight, g/mol:	397.210692
ΔH_f, kcal/mol:	-12.78
Dipole, Da:	4.8
IP(EA), eV:	-8.05(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z,3S,4R)-1-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-(N-methyl-S-phenylsulfonimidoyl)hex-5-en-3-ol

Drug info:

PubChemData

Smile

CC1=C2C=CN=C(C2=CC3=C1N(C4=C3C=C(C=C4)O)C)C5=NC(=CC=C5)C(=O)OC

DOS

IR

Vibrations