Geometry & MOs

Info

ID:	265920
PubChem CID:	103556473
Reduced:	NOSC15H25 (1)
Stoich.:	ABCD15E25 (1)
Weight, g/mol:	259.079763
ΔH_f, kcal/mol:	-47.63
Dipole, Da:	2.85
IP(EA), eV:	-8.68(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-4-methylthiophen-2-yl)-2-(1-methoxycyclobutyl)ethanamine

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(S1)C(CC2(CCC2)OC)N

DOS

IR

Vibrations