Geometry & MOs

Info

ID:	421198
PubChem CID:	135115544
Reduced:	FN4O6C32H39 (1)
Stoich.:	AB4C6D32E39 (1)
Weight, g/mol:	314.210661
ΔH_f, kcal/mol:	-268.56
Dipole, Da:	7.06
IP(EA), eV:	-9.32(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-N-(1H-imidazol-5-ylmethyl)-2,4,6-trimethylbenzamide

Drug info:

PubChemData

Smile

COC1=C2C=CC(=C1)C(=O)NCCCN(CCCC(=O)NCC3=C(O2)C=CC=C3F)C(=O)C4CC(=O)N(C4)C5CCCC5

DOS

IR

Vibrations