Geometry & MOs

Info

ID:	134431
PubChem CID:	51695291
Reduced:	FN2O2H17C21 (1)
Stoich.:	AB2C2D17E21 (1)
Weight, g/mol:	310.168128
ΔH_f, kcal/mol:	-22.16
Dipole, Da:	2.03
IP(EA), eV:	-8.79(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-4-[(2-methylphenyl)methyl]furo[3,2-b]pyrrole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CN2C3=C(C=C2C(=O)NC4=CC=CC=C4F)OC=C3

DOS

IR

Vibrations