Geometry & MOs

Info

ID:	343351
PubChem CID:	127266524
Reduced:	SN2O3C14H22 (1)
Stoich.:	AB2C3D14E22 (1)
Weight, g/mol:	252.089878
ΔH_f, kcal/mol:	-134.33
Dipole, Da:	4.67
IP(EA), eV:	-8.82(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(5-methoxy-1-benzofuran-2-yl)ethenyl]pyrimidine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)N(CCS(=O)(=O)C)C(C)C

DOS

IR

Vibrations