Geometry & MOs

Info

ID:	272214
PubChem CID:	103735743
Reduced:	OSN3C11H19 (1)
Stoich.:	ABC3D11E19 (1)
Weight, g/mol:	193.157898
ΔH_f, kcal/mol:	-32.87
Dipole, Da:	4.14
IP(EA), eV:	-9.16(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-methylcyclobutyl)methyl]-1-(5-methyl-1H-pyrazol-4-yl)methanamine

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC)NCC1=CSC(=N1)C(C)C

DOS

IR

Vibrations