Geometry & MOs

Info

ID:	284477
PubChem CID:	104049463
Reduced:	N2O3C16H20 (1)
Stoich.:	A2B3C16D20 (1)
Weight, g/mol:	292.178693
ΔH_f, kcal/mol:	-100.31
Dipole, Da:	2.63
IP(EA), eV:	-8.98(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2,2-dimethyl-4-(2-methyl-4,5,6,7-tetrahydrobenzimidazol-1-yl)-3-oxobutanoate

Drug info:

PubChemData

Smile

CCOC(=O)C(C)(C)C(=O)CN1C(=NC2=CC=CC=C21)C

DOS

IR

Vibrations