Geometry & MOs

Info

ID:	159263
PubChem CID:	57269362
Reduced:	O6C19H40 (1)
Stoich.:	A6B19C40 (1)
Weight, g/mol:	567.351966
ΔH_f, kcal/mol:	-345.08
Dipole, Da:	3.54
IP(EA), eV:	-10.14(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[[[(2S,3R,4S)-5-cyclohexyl-3-[ethoxy(methoxy)methoxy]-2-hydroxy-4-[(2-methylpropan-2-yl)oxycarbonylamino]pentyl]amino]methyl]carbamate

Drug info:

PubChemData

Smile

C(CCCCO)CCCC(C(CCCO)(C(CCCCCO)O)O)O

DOS

IR

Vibrations