Geometry & MOs

Info

ID:	254155
PubChem CID:	103123130
Reduced:	ON5C13H17 (1)
Stoich.:	AB5C13D17 (1)
Weight, g/mol:	208.132411
ΔH_f, kcal/mol:	38.85
Dipole, Da:	4.9
IP(EA), eV:	-9.41(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-aminocyclobutyl)methyl]-1-methylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1(CN(C1)C(=O)C2=C3C=NC=CN3N=C2)N

DOS

IR

Vibrations