Geometry & MOs

Info

ID:	253792
PubChem CID:	103120684
Reduced:	ON4C14H20 (1)
Stoich.:	AB4C14D20 (1)
Weight, g/mol:	210.148061
ΔH_f, kcal/mol:	5.42
Dipole, Da:	5.71
IP(EA), eV:	-8.9(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-[2-(propan-2-ylamino)ethyl]pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)NCCNC(=O)C1=NN(C2=CC=CC=C21)C

DOS

IR

Vibrations