Geometry & MOs

Info

ID:	49382
PubChem CID:	11532950
Reduced:	SN2O6C24H28 (1)
Stoich.:	AB2C6D24E28 (1)
Weight, g/mol:	472.236208
ΔH_f, kcal/mol:	-200.76
Dipole, Da:	4.97
IP(EA), eV:	-9.54(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R,4S)-4-(5-methyl-1H-imidazol-2-yl)-2,3,4-tris(phenylmethoxy)butan-1-ol

Drug info:

PubChemData

Smile

CCC(C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)NC(=O)/C=C/S(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations