Geometry & MOs

Info

ID:	372650
PubChem CID:	131301598
Reduced:	O2N3C5H11 (1)
Stoich.:	A2B3C5D11 (1)
Weight, g/mol:	159.100777
ΔH_f, kcal/mol:	-92.1
Dipole, Da:	5.63
IP(EA), eV:	-9.53(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3R,4S)-4-hydroxypyrrolidin-3-yl]-3-methylurea

Drug info:

PubChemData

Smile

C1[C@H]([C@@H](CN1)O)NC(=O)N

DOS

IR

Vibrations