Geometry & MOs

Info

ID:	290021
PubChem CID:	104397786
Reduced:	OF2N2C14H22 (1)
Stoich.:	AB2C2D14E22 (1)
Weight, g/mol:	270.149891
ΔH_f, kcal/mol:	-123.85
Dipole, Da:	2.69
IP(EA), eV:	-8.87(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-[(3-chloro-5-methylphenyl)methyl]-1-N-(2-methoxyethyl)propane-1,2-diamine

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1)F)CNC(C)CNCCOC)F

DOS

IR

Vibrations