Geometry & MOs

Info

ID:	212078
PubChem CID:	81059397
Reduced:	BrNSO6C11H16 (1)
Stoich.:	ABCD6E11F16 (1)
Weight, g/mol:	202.204513
ΔH_f, kcal/mol:	-220.11
Dipole, Da:	11.8
IP(EA), eV:	-9.36(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(2-ethoxyethyl)-2-N,2,3-trimethylbutane-1,2-diamine

Drug info:

PubChemData

Smile

CC(C)OCCN(C)S(=O)(=O)C1=C(OC(=C1)C(=O)O)Br

DOS

IR

Vibrations