Geometry & MOs

Info

ID:	421086
PubChem CID:	135115365
Reduced:	N3O3C18H25 (1)
Stoich.:	A3B3C18D25 (1)
Weight, g/mol:	352.171082
ΔH_f, kcal/mol:	-114.25
Dipole, Da:	1.69
IP(EA), eV:	-9.06(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-3,5-difluoro-4-methoxy-N-[(5-methyl-1H-imidazol-4-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)C(=O)C3=CC=C(C=C3)C(=O)N)CO

DOS

IR

Vibrations