Geometry & MOs

Info

ID:	252433
PubChem CID:	103111358
Reduced:	SN3O3C14H23 (1)
Stoich.:	AB3C3D14E23 (1)
Weight, g/mol:	251.17461
ΔH_f, kcal/mol:	-112.0
Dipole, Da:	10.71
IP(EA), eV:	-8.91(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(dimethylamino)pyrimidin-4-yl]amino]-N-ethyl-N-methylpropanamide

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC1=CC=C(C=C1)S(=O)(=O)N(C)C

DOS

IR

Vibrations