Geometry & MOs

Info

ID:	49030
PubChem CID:	11528632
Reduced:	ON2C13H18 (1)
Stoich.:	AB2C13D18 (1)
Weight, g/mol:	218.178299
ΔH_f, kcal/mol:	-0.25
Dipole, Da:	3.22
IP(EA), eV:	-9.21(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N',N'-diethyl-N-(1-phenylethenyl)ethane-1,2-diamine

Drug info:

PubChemData

Smile

CC[C@@H](CO)N(CC#N)CC1=CC=CC=C1

DOS

IR

Vibrations