Geometry & MOs

Info

ID:	271060
PubChem CID:	103641769
Reduced:	SN2C18H26 (1)
Stoich.:	AB2C18D26 (1)
Weight, g/mol:	273.155121
ΔH_f, kcal/mol:	23.74
Dipole, Da:	2.5
IP(EA), eV:	-7.99(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-ethylthiophen-2-yl)-N-[(2,4,5-trimethylphenyl)methyl]methanamine

Drug info:

PubChemData

Smile

CCC1=CC=C(S1)CNCC2=CC=C(C=C2)N(CC)CC

DOS

IR

Vibrations