Geometry & MOs

Info

ID:	421053
PubChem CID:	135115292
Reduced:	O2N3C22H27 (1)
Stoich.:	A2B3C22D27 (1)
Weight, g/mol:	311.144533
ΔH_f, kcal/mol:	-49.59
Dipole, Da:	4.08
IP(EA), eV:	-8.85(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,3-difluoro-6-methoxyphenyl)methyl-[(5-methyl-1H-imidazol-4-yl)methyl]amino]ethanol

Drug info:

PubChemData

Smile

CC1=NC=C2CCC3(C2=N1)CCCN(C3)C(=O)CCC4=CC=CC=C4OC

DOS

IR

Vibrations