Geometry & MOs

Info

ID:	278803
PubChem CID:	103838376
Reduced:	NO2C17H27 (1)
Stoich.:	AB2C17D27 (1)
Weight, g/mol:	289.11365
ΔH_f, kcal/mol:	-101.64
Dipole, Da:	1.34
IP(EA), eV:	-8.72(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dihydro-2H-chromen-4-ylmethylamino)-1-thiophen-3-ylethanol

Drug info:

PubChemData

Smile

CC(C)(C)CC(CNCC1CCOC2=CC=CC=C12)O

DOS

IR

Vibrations