Geometry & MOs

Info

ID:	294036
PubChem CID:	117423231
Reduced:	ClNO2C14H18 (1)
Stoich.:	ABC2D14E18 (1)
Weight, g/mol:	267.084849
ΔH_f, kcal/mol:	-68.78
Dipole, Da:	2.57
IP(EA), eV:	-8.95(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-chloro-4-(thian-4-yl)phenyl]cyclopropan-1-amine

Drug info:

PubChemData

Smile

C1CCC(CC1)(CN)C2=C(C=CC3=C2OCO3)Cl

DOS

IR

Vibrations