Geometry & MOs

Info

ID:	336066
PubChem CID:	127255073
Reduced:	O3N5C23H25 (1)
Stoich.:	A3B5C23D25 (1)
Weight, g/mol:	410.231791
ΔH_f, kcal/mol:	-13.45
Dipole, Da:	2.39
IP(EA), eV:	-8.36(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-hydroxy-2-methyl-6-oxopyridin-1-yl)-N-[(1S)-1-[1-(2-methylpropyl)benzimidazol-2-yl]ethyl]butanamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CCC2=NC(=NN2)NC(=O)CCC3=CNC4=CC=CC=C43)OC

DOS

IR

Vibrations