Geometry & MOs

Info

ID:	244448
PubChem CID:	99355565
Reduced:	FON5C19H22 (1)
Stoich.:	ABC5D19E22 (1)
Weight, g/mol:	355.180839
ΔH_f, kcal/mol:	-21.28
Dipole, Da:	6.45
IP(EA), eV:	-8.82(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(R)-(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-4-(2-methylimidazol-1-yl)butanamide

Drug info:

PubChemData

Smile

CC1=NC=CN1CCCC(=O)N[C@@H](C2=CC=C(C=C2)F)C3=NC=CN3C

DOS

IR

Vibrations