Geometry & MOs

Info

ID:	419929
PubChem CID:	135109822
Reduced:	N3O3C25H41 (1)
Stoich.:	A3B3C25D41 (1)
Weight, g/mol:	315.149538
ΔH_f, kcal/mol:	-133.81
Dipole, Da:	2.18
IP(EA), eV:	-8.34(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-N-methyl-4-pyrazol-1-ylbutanamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CCOC2=CC=CC=C2CN3CCC4(CC3)CC(CCO4)(C)O

DOS

IR

Vibrations