Geometry & MOs

Info

ID:	130772
PubChem CID:	51104638
Reduced:	FO2N3C19H26 (1)
Stoich.:	AB2C3D19E26 (1)
Weight, g/mol:	325.19026
ΔH_f, kcal/mol:	-83.69
Dipole, Da:	3.11
IP(EA), eV:	-8.98(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(imidazol-1-ylmethyl)phenyl]-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]methanamine

Drug info:

PubChemData

Smile

CN1C(=CC=N1)C2CCN(CC2)CC(COCC3=CC=CC=C3F)O

DOS

IR

Vibrations