Geometry & MOs

Info

ID:	417692
PubChem CID:	135102501
Reduced:	ON2C10H14 (2)
Stoich.:	AB2C10D14 (2)
Weight, g/mol:	282.173213
ΔH_f, kcal/mol:	-57.09
Dipole, Da:	5.82
IP(EA), eV:	-9.06(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2,5-trimethyl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrrole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NC=C(N1)CN(CCO)C(=O)C2CCCCN2CC3=CC=CC=C3

DOS

IR

Vibrations