Geometry & MOs

Info

ID:	80658
PubChem CID:	49835780
Reduced:	FN9C23H30 (1)
Stoich.:	AB9C23D30 (1)
Weight, g/mol:	307.163102
ΔH_f, kcal/mol:	64.5
Dipole, Da:	3.51
IP(EA), eV:	-8.62(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-[(4R,5R)-5-[(1R)-1,2-dihydroxyethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethoxyethyl]acetamide

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)F)NC2=NC(=NC(=N2)NC3=NNC(=C3)C4CCC4)N5CCN(CC5)C

DOS

IR

Vibrations