Geometry & MOs

Info

ID:	281199
PubChem CID:	103911386
Reduced:	ClNOSC14H22 (1)
Stoich.:	ABCDE14F22 (1)
Weight, g/mol:	313.06774
ΔH_f, kcal/mol:	-35.56
Dipole, Da:	5.76
IP(EA), eV:	-8.36(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromophenyl)-2-[(2-methyloxan-4-yl)amino]ethanol

Drug info:

PubChemData

Smile

CC(CCNC(C)CC1=CC=C(C=C1)Cl)S(=O)C

DOS

IR

Vibrations