Geometry & MOs

Info

ID:	372896
PubChem CID:	131306655
Reduced:	ClOSN2H9C11 (1)
Stoich.:	ABCD2E9F11 (1)
Weight, g/mol:	206.141913
ΔH_f, kcal/mol:	17.41
Dipole, Da:	4.66
IP(EA), eV:	-9.36(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N,N-dimethyl-3-propan-2-ylbenzamide

Drug info:

PubChemData

Smile

CC1=NC(=C(C=C1)C2=NC(=C(S2)C=O)C)Cl

DOS

IR

Vibrations