Geometry & MOs

Info

ID:	270723
PubChem CID:	103637842
Reduced:	SN2C16H22 (1)
Stoich.:	AB2C16D22 (1)
Weight, g/mol:	262.204513
ΔH_f, kcal/mol:	56.81
Dipole, Da:	2.71
IP(EA), eV:	-8.54(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-cyclopropyl-N'-ethyl-N-[(4-methoxy-3-methylphenyl)methyl]ethane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(CCNCC1=CSC2=CC=CC=C21)C3CC3

DOS

IR

Vibrations