Geometry & MOs

Info

ID:	324509
PubChem CID:	126677787
Reduced:	N5C16H19 (1)
Stoich.:	A5B16C19 (1)
Weight, g/mol:	279.97087
ΔH_f, kcal/mol:	55.86
Dipole, Da:	4.19
IP(EA), eV:	-8.14(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-4-(3-iodopyrazol-1-yl)oxolan-3-ol

Drug info:

PubChemData

Smile

CCN1C=CC2=C(C=CC=C21)CC3=CC(=NC(=C3N)N)N

DOS

IR

Vibrations