Geometry & MOs

Info

ID:	64769
PubChem CID:	29203973
Reduced:	N3O3C22H25 (1)
Stoich.:	A3B3C22D25 (1)
Weight, g/mol:	235.132077
ΔH_f, kcal/mol:	-38.71
Dipole, Da:	5.15
IP(EA), eV:	-8.09(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-3-(carbamoylamino)benzamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C1=CN(N=C1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3

DOS

IR

Vibrations