Geometry & MOs

Info

ID:	270743
PubChem CID:	103637912
Reduced:	ON2C16H26 (1)
Stoich.:	AB2C16D26 (1)
Weight, g/mol:	236.168877
ΔH_f, kcal/mol:	-9.56
Dipole, Da:	2.65
IP(EA), eV:	-8.65(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-cyclopropyl-N'-ethyl-N-[(3-fluorophenyl)methyl]ethane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(CCNCC1=CC=CC=C1OCC)C2CC2

DOS

IR

Vibrations