Geometry & MOs

Info

ID:	278745
PubChem CID:	103837522
Reduced:	BrSN3C9H12 (1)
Stoich.:	ABC3D9E12 (1)
Weight, g/mol:	223.087625
ΔH_f, kcal/mol:	85.67
Dipole, Da:	5.41
IP(EA), eV:	-9.06(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[(1-cyclopropylcyclopropyl)methyl]pyrimidin-4-amine

Drug info:

PubChemData

Smile

C1CC1C2(CC2)CNC3=NN=C(S3)Br

DOS

IR

Vibrations