Geometry & MOs

Info

ID:	367333
PubChem CID:	127324222
Reduced:	ON6C12H20 (1)
Stoich.:	AB6C12D20 (1)
Weight, g/mol:	299.155767
ΔH_f, kcal/mol:	22.65
Dipole, Da:	5.13
IP(EA), eV:	-9.15(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclopropylpyrrolidin-3-yl)-3-[[1-(difluoromethyl)imidazol-2-yl]methyl]urea

Drug info:

PubChemData

Smile

C1CC1N2CCC(C2)NC(=O)NCCN3C=NC=N3

DOS

IR

Vibrations