Geometry & MOs

Info

ID:	325675
PubChem CID:	126684431
Reduced:	ClSO4N5C20H22 (1)
Stoich.:	ABC4D5E20F22 (1)
Weight, g/mol:	190.146999
ΔH_f, kcal/mol:	-91.76
Dipole, Da:	4.26
IP(EA), eV:	-8.72(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,2-dimethyl-N-(3-methylbut-1-en-2-yl)pyridin-4-amine

Drug info:

PubChemData

Smile

CC[C@@H](COS(=O)(=O)N)[C@H](CN1C=CC2=C(N=CN=C21)C3=CC4=C(N3)C=C(C=C4)Cl)O

DOS

IR

Vibrations