Geometry & MOs

Info

ID:	208382
PubChem CID:	80526818
Reduced:	NOSC18H25 (1)
Stoich.:	ABCD18E25 (1)
Weight, g/mol:	319.116149
ΔH_f, kcal/mol:	-17.31
Dipole, Da:	2.12
IP(EA), eV:	-8.64(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-chlorophenyl)-cyclopropylmethyl]-2-methyl-2-thiophen-2-ylpropan-1-amine

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C(C)NCC(C)(C)C2=CC=CS2

DOS

IR

Vibrations