Geometry & MOs

Info

ID:	32033
PubChem CID:	4253820
Reduced:	ON4C23H26 (1)
Stoich.:	AB4C23D26 (1)
Weight, g/mol:	453.188626
ΔH_f, kcal/mol:	17.66
Dipole, Da:	7.71
IP(EA), eV:	-8.95(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-[butyl-[(2-fluorophenyl)carbamoyl]amino]-N-(thiophen-2-ylmethyl)acetamide

Drug info:

PubChemData

Smile

C1CC2CC(CC(C1)N2CC3=CC=CC=C3)NC(=O)NC4=CC=C(C=C4)C#N

DOS

IR

Vibrations