Geometry & MOs

Info

ID:	171673
PubChem CID:	75412723
Reduced:	O2S2N3H17C19 (1)
Stoich.:	A2B2C3D17E19 (1)
Weight, g/mol:	257.105193
ΔH_f, kcal/mol:	-1.19
Dipole, Da:	5.29
IP(EA), eV:	-8.36(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pyridin-2-ylmethyl 2-(3-methoxyphenyl)acetate

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC4=C(S3)CCC4

DOS

IR

Vibrations