Geometry & MOs

Info

ID:	212914
PubChem CID:	81062239
Reduced:	N3O3C11H23 (1)
Stoich.:	A3B3C11D23 (1)
Weight, g/mol:	251.08848
ΔH_f, kcal/mol:	-115.35
Dipole, Da:	4.53
IP(EA), eV:	-8.73(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-methyl-N-(2-propan-2-yloxyethyl)butan-1-amine

Drug info:

PubChemData

Smile

CCOCCN(C)C(=O)C(C(C)C)C(=NO)N

DOS

IR

Vibrations