Geometry & MOs

Info

ID:	416781
PubChem CID:	135090344
Reduced:	NSO4C17H17 (1)
Stoich.:	ABC4D17E17 (1)
Weight, g/mol:	383.232125
ΔH_f, kcal/mol:	-118.71
Dipole, Da:	5.46
IP(EA), eV:	-8.52(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-5-methoxy-1,2-dimethyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]indole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2S1)CN3C[C@]4(C[C@]4(C3)C(=O)O)C(=O)O

DOS

IR

Vibrations