Geometry & MOs

Info

ID:	414943
PubChem CID:	135087923
Reduced:	NO6C15H19 (1)
Stoich.:	AB6C15D19 (1)
Weight, g/mol:	312.195011
ΔH_f, kcal/mol:	-240.25
Dipole, Da:	11.03
IP(EA), eV:	-9.53(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-N-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1H-indene-2-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C(=O)O)CN2CC[C@@H]([C@@H](C2)O)C(=O)O

DOS

IR

Vibrations