Geometry & MOs

Info

ID:	241015
PubChem CID:	93621187
Reduced:	N2O3C18H24 (1)
Stoich.:	A2B3C18D24 (1)
Weight, g/mol:	314.163043
ΔH_f, kcal/mol:	-90.46
Dipole, Da:	5.96
IP(EA), eV:	-8.91(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-2-oxo-N-[(4R)-2,6,6-trimethyl-5,7-dihydro-4H-1-benzofuran-4-yl]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(O1)CC(C[C@H]2NC(=O)CC3=C(ON=C3C)C)(C)C

DOS

IR

Vibrations