Geometry & MOs

Info

ID:	413067
PubChem CID:	135086011
Reduced:	IN2O2C15H17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	410.04912
ΔH_f, kcal/mol:	-4.46
Dipole, Da:	5.06
IP(EA), eV:	-8.87(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-iodo-1-(methoxymethyl)-N,N-bis(prop-2-enyl)indole-3-carboxamide

Drug info:

PubChemData

Smile

CN(CC=C)C(=O)C1=C(N(C2=CC=CC=C21)COC)I

DOS

IR

Vibrations