Geometry & MOs

Info

ID:	10039
PubChem CID:	96549
Reduced:	FCl2N2C19H21 (1)
Stoich.:	AB2C2D19E21 (1)
Weight, g/mol:	366.106582
ΔH_f, kcal/mol:	-18.87
Dipole, Da:	4.66
IP(EA), eV:	-8.47(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-bis(2-chloroethyl)-4-[(4-fluoro-2-methylphenyl)iminomethyl]-3-methylaniline

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)N(CCCl)CCCl)C=NC2=C(C=C(C=C2)F)C

DOS

IR

Vibrations