Geometry & MOs

Info

ID:	183860
PubChem CID:	77082642
Reduced:	N2O2C19H26 (1)
Stoich.:	A2B2C19D26 (1)
Weight, g/mol:	324.206245
ΔH_f, kcal/mol:	-66.02
Dipole, Da:	1.71
IP(EA), eV:	-7.93(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(3,5-dimethylpyrazol-1-yl)phenyl]-N-[(2-ethyl-1,2,4-triazol-3-yl)methyl]-N-methylmethanamine

Drug info:

PubChemData

Smile

CC1=C(NC2=C1C=C(C=C2)OC)CN3CCOC4(C3)CCCC4

DOS

IR

Vibrations