Geometry & MOs

Info

ID:	265912
PubChem CID:	103556427
Reduced:	BrNOSC14H22 (1)
Stoich.:	ABCDE14F22 (1)
Weight, g/mol:	245.064113
ΔH_f, kcal/mol:	-23.95
Dipole, Da:	2.19
IP(EA), eV:	-8.89(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chlorothiophen-2-yl)-2-(1-methoxycyclobutyl)ethanamine

Drug info:

PubChemData

Smile

CCNC(CC1(CCC1)OC)C2=CC(=C(S2)Br)C

DOS

IR

Vibrations