Geometry & MOs

Info

ID:	414735
PubChem CID:	135087696
Reduced:	N2O3C22H26 (1)
Stoich.:	A2B3C22D26 (1)
Weight, g/mol:	297.135638
ΔH_f, kcal/mol:	-90.75
Dipole, Da:	6.93
IP(EA), eV:	-9.01(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-chloro-1,3-dimethylpyrazol-4-yl)methyl-[(5-methyl-1H-imidazol-4-yl)methyl]amino]ethanol

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C3(CCN(CC3)C(=O)CCC4=CC=NC=C4)OCC2

DOS

IR

Vibrations