Geometry & MOs

Info

ID:	270714
PubChem CID:	103637800
Reduced:	ClON2C14H21 (1)
Stoich.:	ABC2D14E21 (1)
Weight, g/mol:	300.16602
ΔH_f, kcal/mol:	-21.96
Dipole, Da:	3.5
IP(EA), eV:	-8.8(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-cyclopropyl-N'-ethyl-N-[(4-phenylthiophen-2-yl)methyl]ethane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(CCNCC1=C(C=CC(=C1)Cl)O)C2CC2

DOS

IR

Vibrations