Geometry & MOs

Info

ID:	282599
PubChem CID:	103932474
Reduced:	ON3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	243.173548
ΔH_f, kcal/mol:	5.5
Dipole, Da:	1.14
IP(EA), eV:	-7.91(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-1-methyl-N-[1-(3-methylphenyl)ethyl]pyrazol-4-amine

Drug info:

PubChemData

Smile

CCC1=NN(C=C1NC(CC)C2=CC=C(C=C2)OC)C

DOS

IR

Vibrations