Geometry & MOs

Info

ID:	255361
PubChem CID:	103131589
Reduced:	NC4H5 (3)
Stoich.:	AB4C5 (3)
Weight, g/mol:	235.087625
ΔH_f, kcal/mol:	53.33
Dipole, Da:	4.98
IP(EA), eV:	-8.83(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-chloro-2-(1-methylpyrazol-3-yl)phenyl]-N-methylmethanamine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)CN)C2=NN(C=C2)C

DOS

IR

Vibrations