Geometry & MOs

Info

ID:	344264
PubChem CID:	127267440
Reduced:	O3N4C18H22 (1)
Stoich.:	A3B4C18D22 (1)
Weight, g/mol:	313.142641
ΔH_f, kcal/mol:	-73.86
Dipole, Da:	7.6
IP(EA), eV:	-8.61(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[1-[2-(3-methylimidazol-4-yl)acetyl]-2,3-dihydroindol-2-yl]acetate

Drug info:

PubChemData

Smile

CC(C)(C)N1C=NC(=N1)C(=O)N2C(CC3=CC=CC=C32)CC(=O)OC

DOS

IR

Vibrations