Geometry & MOs

Info

ID:	126415
PubChem CID:	50964143
Reduced:	ON6C21H22 (1)
Stoich.:	AB6C21D22 (1)
Weight, g/mol:	373.142641
ΔH_f, kcal/mol:	58.89
Dipole, Da:	4.31
IP(EA), eV:	-9.0(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[5-(4-methyl-2-oxochromen-7-yl)-4-phenylimidazol-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C(=O)N=C(N1)C)CC2=NC(=NN2C3=CC=CC4=C3N=CC=C4)C(C)C

DOS

IR

Vibrations