Geometry & MOs

Info

ID:	369170
PubChem CID:	127331471
Reduced:	N3O3C23H33 (1)
Stoich.:	A3B3C23D33 (1)
Weight, g/mol:	359.220892
ΔH_f, kcal/mol:	-113.04
Dipole, Da:	6.38
IP(EA), eV:	-8.62(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-tert-butyloxan-3-yl)methyl]-4-(2-oxoimidazolidin-1-yl)benzamide

Drug info:

PubChemData

Smile

CC(C)(C)C1C(CCCO1)CNC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3

DOS

IR

Vibrations