Geometry & MOs

Info

ID:	313218
PubChem CID:	126612629
Reduced:	ClN2O2C11H17 (1)
Stoich.:	AB2C2D11E17 (1)
Weight, g/mol:	186.115698
ΔH_f, kcal/mol:	-74.53
Dipole, Da:	7.18
IP(EA), eV:	-9.98(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2S)-2,3-dihydro-1H-indol-2-yl]-N-prop-1-en-2-ylmethanimine

Drug info:

PubChemData

Smile

C=CCNC(=O)C(CCCl)C(=O)NCC=C

DOS

IR

Vibrations