Geometry & MOs

Info

ID:	254172
PubChem CID:	103123233
Reduced:	ON5C13H17 (1)
Stoich.:	AB5C13D17 (1)
Weight, g/mol:	258.148061
ΔH_f, kcal/mol:	27.28
Dipole, Da:	3.15
IP(EA), eV:	-9.36(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-amino-2-phenylpropan-2-yl)-1-methylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1(C(CC1NC(=O)C2=C3C=NC=CN3N=C2)N)C

DOS

IR

Vibrations