Geometry & MOs

Info

ID:	208650
PubChem CID:	80559805
Reduced:	SN2O2C9H18 (1)
Stoich.:	AB2C2D9E18 (1)
Weight, g/mol:	229.132746
ΔH_f, kcal/mol:	-94.9
Dipole, Da:	5.88
IP(EA), eV:	-9.29(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-(6-pyrazol-1-ylpyridin-3-yl)cyclobutane-1,3-diamine

Drug info:

PubChemData

Smile

CC1(CCS(=O)(=O)C1)NC2CC(C2)N

DOS

IR

Vibrations