Geometry & MOs

Info

ID:	280819
PubChem CID:	103851458
Reduced:	N3C17H25 (1)
Stoich.:	A3B17C25 (1)
Weight, g/mol:	225.184112
ΔH_f, kcal/mol:	21.78
Dipole, Da:	2.02
IP(EA), eV:	-8.72(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[(2-methylpropan-2-yl)oxy]ethanamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)C(C)NCC2=C(N(N=C2)C)C)C

DOS

IR

Vibrations