Geometry & MOs

Info

ID:	274748
PubChem CID:	103811481
Reduced:	ON4C12H20 (1)
Stoich.:	AB4C12D20 (1)
Weight, g/mol:	210.148061
ΔH_f, kcal/mol:	-23.52
Dipole, Da:	2.78
IP(EA), eV:	-8.2(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(1,3-dimethylpyrazol-4-yl)-3-methylbutanamide

Drug info:

PubChemData

Smile

CC1=NN(C=C1NC(=O)C2(CCCC2)CN)C

DOS

IR

Vibrations