Geometry & MOs

Info

ID:	423076
PubChem CID:	135118876
Reduced:	FN4O6C35H39 (1)
Stoich.:	AB4C6D35E39 (1)
Weight, g/mol:	241.142641
ΔH_f, kcal/mol:	-231.52
Dipole, Da:	10.18
IP(EA), eV:	-9.02(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethoxy-N-(2-hydroxyethyl)-N-(1H-imidazol-2-ylmethyl)propanamide

Drug info:

PubChemData

Smile

COC1=C2C=CC(=C1)C(=O)NCCCN(CCCC(=O)NCC3=C(O2)C=CC=C3F)C(=O)C4CCCCN4C(=O)C5=CC=CC=C5

DOS

IR

Vibrations