Geometry & MOs

Info

ID:	232037
PubChem CID:	87575237
Reduced:	NSO5H19C25 (1)
Stoich.:	ABC5D19E25 (1)
Weight, g/mol:	186.209599
ΔH_f, kcal/mol:	-102.72
Dipole, Da:	2.92
IP(EA), eV:	-8.87(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-N',N'-di(propan-2-yl)propane-1,3-diamine

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)O

DOS

IR

Vibrations