Geometry & MOs

Info

ID:	190198
PubChem CID:	77967048
Reduced:	BrNOC6H8 (2)
Stoich.:	ABCD6E8 (2)
Weight, g/mol:	320.246378
ΔH_f, kcal/mol:	-75.32
Dipole, Da:	3.63
IP(EA), eV:	-9.52(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[[3-(2,2-dimethylpropyl)-5-ethylphenyl]methylamino]-2-hydroxypropyl]acetamide

Drug info:

PubChemData

Smile

CC(=O)NCC(CNCC1=CC(=CC(=C1)Br)Br)O

DOS

IR

Vibrations