Geometry & MOs

Info

ID:	432253
PubChem CID:	135172385
Reduced:	SN4O4C30H34 (1)
Stoich.:	AB4C4D30E34 (1)
Weight, g/mol:	303.183444
ΔH_f, kcal/mol:	-109.02
Dipole, Da:	9.64
IP(EA), eV:	-9.34(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-ethoxycyclobutyl)oxy-2-(5-ethoxypent-1-ynyl)pyridine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C2=C(N=CS2)C)CNC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](C(C)C)N4CC5=CC=CC=C5C4=O)O

DOS

IR

Vibrations